CID 10751321

187401-16-7

Structural Information

Molecular Formula
C13H18N2O
SMILES
CC1(CCC(C2=NC(=CN=C21)C=O)(C)C)C
InChI
InChI=1S/C13H18N2O/c1-12(2)5-6-13(3,4)11-10(12)14-7-9(8-16)15-11/h7-8H,5-6H2,1-4H3
InChIKey
JYUBFGIHUCBSRM-UHFFFAOYSA-N
Compound name
5,5,8,8-tetramethyl-6,7-dihydroquinoxaline-2-carbaldehyde
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

25
Patents

218.1419 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 219.14918 148.1
[M+Na]+ 241.13112 158.3
[M-H]- 217.13462 150.4
[M+NH4]+ 236.17572 169.6
[M+K]+ 257.10506 155.3
[M+H-H2O]+ 201.13916 141.4
[M+HCOO]- 263.14010 166.2
[M+CH3COO]- 277.15575 190.7
[M+Na-2H]- 239.11657 155.6
[M]+ 218.14135 149.0
[M]- 218.14245 149.0
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe